| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 25th, 2007 | 31 | Yes |
None
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 5.33 | 11.02 | -10.67 | 2 | 5 | 0 | 69 | 474.358 | 5 | ↓ |
| Ref Reference (pH 7) | 5.33 | 11.15 | -11.9 | 2 | 5 | 0 | 69 | 474.358 | 5 | ↓ |
| Hi High (pH 8-9.5) | 5.33 | 11.92 | -43.64 | 1 | 5 | -1 | 72 | 473.35 | 5 | ↓ |
| Mid Mid (pH 6-8) | 5.33 | 11.79 | -49.84 | 1 | 5 | -1 | 72 | 473.35 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.